| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 2TSZ8HW6DQ |
| EPA CompTox | DTXSID0061583 |
Structure
| InChI Key | QJQAMHYHNCADNR-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C4H9N1O1 |
| Molecular Weight | 87.07 |
| AlogP | 0.98 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 32.59 |
| Heavy Atoms | 6.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 1187-58-2 |
| NORMAN SUSDAT | |
| FDA SRS | 2TSZ8HW6DQ |
| PubChem | 14470 |
| ChemSpider | 13816.0 |
CONTENTS
